Geometry & MOs

Info

ID:	341291
PubChem CID:	127263984
Reduced:	Cl2N3C12H15 (1)
Stoich.:	A2B3C12D15 (1)
Weight, g/mol:	330.003809
ΔH_f, kcal/mol:	-7.03
Dipole, Da:	4.36
IP(EA), eV:	-9.24(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5,7-dichloro-2-methyl-1H-indol-3-yl)propan-1-amine;dihydrochloride

Drug info:

PubChemData

Smile

C1=CC(=C2C(=C1)C(=CN2)CCCN)C#N.Cl.Cl

DOS

IR

Vibrations